4'-Chlorosuccinanilic acid
Basic information
- CAS
17722-52-0- Standard SMILES
O=C(O)CCC(=O)Nc1ccc(Cl)cc1- InChIKey
UPSNSRKMOHOEEO-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO3
- Average molar mass
- 227.64 g/mol
- Monoisotopic mass
- 227.0349209
Names & identifiers
- Preferred name
- 4'-Chlorosuccinanilic acid
- IUPAC
- 4-(4-chloroanilino)-4-oxobutanoic acid
- English name
- 4-[(4-Chlorophenyl)amino]-4-oxobutanoic acid
- Molecular formula
- C10H10ClNO3
- Molecular weight
- 227.64
Names & synonyms
4'-chlorosuccinanilic acidRefChem:506075666-160-417722-52-0N-(4-CHLOROPHENYL)SUCCINAMIC ACID4-[(4-chlorophenyl)amino]-4-oxobutanoic acid4-(4-chloroanilino)-4-oxobutanoic acidbutanoic acid, 4-[(4-chlorophenyl)amino]-4-oxo-3-[(4-chlorophenyl)carbamoyl]propanoic acidMFCD00029843NSC11001NSC-11001
Show more names
AURORA 2782ASISCHEM D13214BUTTPARK 41\07-63IFLAB-BB F0358-0044OTAVA-BB BB0110420277N-(4-Chloro-phenyl)-succinamic acid4-[(4-chlorophenyl)amino]-4-keto-butyric acid
3-[N-(4-chlorophenyl)carbamoyl]propanoic acid4-((4-chlorophenyl)amino)-4-oxobutanoic acid4'-chlorosucOprea1_34803835USS776BHIFLab1_001224SCHEMBL7827734SCHEMBL9868062
Database identifiers
- CAS
17722-52-0、2104-66-7- PubChem CID
- 223382
- DTXSID
DTXSID30279000- UNII
- 35USS776BH
- EC Number
- 666-160-4
- Nikkaji
- J2.736.976F
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 237
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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